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Concept information

... > organooxygen compound > ester > lactone > gamma-lactone > butenolide > daibulactone a, (rel)-
... > organooxygen compound > oxacycle > lactone > gamma-lactone > butenolide > daibulactone a, (rel)-
organooxygen compound > oxacycle > furans > butenolide > daibulactone a, (rel)-

Preferred term

daibulactone a, (rel)-  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C17H18O5

has_role

inchi

  • InChI=1S/C17H18O5/c1-9-4-13(21-11(3)18)6-12-7-15(22-17(12)19)16-10(2)8-20-14(16)5-9/h4,7-8,13,15H,5-6H2,1-3H3/b9-4+/t13-,15+/m0/s1

inchikey

  • IAFGRUKVDHTZPP-MXXQPQJVSA-N

mass

  • 302.32180

monoisotopicmass

  • 302.11542

smiles

  • [H][C@]12OC(=O)C(C[C@@H](OC(C)=O)/C=C(C)/Cc3occ(C)c13)=C2

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69070

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